4-benzoyl-1,3-phenylene bis(4-bromo-3-nitrobenzoate)
Chemical Structure Depiction of
4-benzoyl-1,3-phenylene bis(4-bromo-3-nitrobenzoate)
4-benzoyl-1,3-phenylene bis(4-bromo-3-nitrobenzoate)
Compound characteristics
| Compound ID: | 0466-0368 |
| Compound Name: | 4-benzoyl-1,3-phenylene bis(4-bromo-3-nitrobenzoate) |
| Molecular Weight: | 670.22 |
| Molecular Formula: | C27 H14 Br2 N2 O9 |
| Smiles: | c1ccc(cc1)C(c1ccc(cc1OC(c1ccc(c(c1)[N+]([O-])=O)[Br])=O)OC(c1ccc(c(c1)[N+]([O-])=O)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.232 |
| logD: | 6.232 |
| logSw: | -6.0898 |
| Hydrogen bond acceptors count: | 16 |
| Polar surface area: | 120.709 |
| InChI Key: | AIZRKHUVNYHHNQ-UHFFFAOYSA-N |